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20002022
most citedPDFgetX3: A rapid and highly automatable program for processing powder diffraction data into total scattering pair distribution functions

1.3k citations · 2k across the 22 of their papers we have counts for

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Showing 2019Show all

8 papers · 1 filter

cond-mat.mtrl-sci2019

Understanding Electronic Peculiarities in Tetragonal FeSe as Local Structural Symmetry Breaking

Zhi Wang, Xingang Zhao, Robert Koch +2

Traditional band theory of perfect crystalline solids often uses as input the structure deduced from diffraction experiments; when modeled by the minimal unit cell this often produ…

cond-mat.mtrl-sci2019

sasPDF: pair distribution function analysis of nanoparticle assemblies from small-angle-scattering data

Chia-Hao Liu, Eric M. Janke, Ruipen Li +4

We extends pair distribution function (PDF) analysis into the small-angle scattering (SAS) regime and describe the data collection protocol for optimum data quality. We also presen…

cond-mat.mtrl-sci2019

Structure-mining: screening structure models by automated fitting to the atomic pair distribution function over large numbers of models

Long Yang, Pavol Juhás, Maxwell W. Terban +2

A new approach is presented to obtain candidate structures from atomic pair distribution function (PDF) data in a highly automated way. It fetches, from web-based structural databa…

cond-mat.supr-con201921 cited

Photoinduced ultrafast dynamics of local nematicity and lattice distortions in FeSe crystals

T. Konstantinova, L. Wu, M. Abeykoon +12

Formation of electronic nematicity is a common thread of unconventional superconductors. In iron-based materials, the long-range nematic order is revealed by the orthorhombic latti…

cond-mat.mtrl-sci2019

Using a machine learning approach to determine the space group of a structure from the atomic pair distribution function (PDF)

Chia-Hao Liu, Yunzhe Tao, Daniel Hsu +2

We present a method for predicting the space group of a structure given a calculated or measured atomic pair distribution function (PDF) from that structure. The method utilizes ma…

cond-mat.supr-con201934 cited

Room temperature local nematicity in FeSe superconductor

R. J. Koch, T. Konstantinova, M. Abeykoon +5

We report pair distribution function measurements of the iron-based superconductor FeSe above and below the structural transition temperature. Structural analysis reveals a local o…